0 mol 41 unq 0 iso 0 dist 8.45063 5.14132 6.59367 5.31016 12.5752 6.73801 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 8.45063 5.14132 6.59367 9.57818 8.68242 6.42834 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 5.41134 8.85727 8.10708 10.4651 9.98108 9.43355 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 5.41134 8.85727 8.10708 15.5157 12.8035 7.9327 numMergedOcc 0
4 mol 59 unq 2 iso 0 dist 8.61357 4.07863 8.10708 7.69638 9.98108 9.43355 numMergedOcc 0
5 mol 59 unq 3 iso 0 dist 8.61357 4.07863 8.10708 11.9788 12.8035 7.9327 numMergedOcc 0
6 mol 59 unq 4 iso 0 dist 9.23605 8.85727 9.20253 10.4651 15.8562 9.43355 numMergedOcc 0
7 mol 59 unq 5 iso 0 dist 9.23605 8.85727 9.20253 15.5157 10.3701 7.9327 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 7.67429 4.6158 9.66069 10.2858 11.1384 6.49383 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 5.9962 11.4175 6.61636 16.5968 10.745 6.51868 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 5.9962 11.4175 6.61636 16.1811 11.3682 7.34698 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 8.61448 6.2062 6.61636 11.4454 10.745 6.51868 numMergedOcc 0
12 mol 133 unq 3 iso 0 dist 8.61448 6.2062 6.61636 7.31633 11.3682 7.34698 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 6.7407 10.5012 7.33162 9.38737 4.67407 8.41245 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 6.7407 10.5012 7.33162 12.6042 6.34062 6.64779 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 7.7013 4.65504 7.77669 7.98682 10.3139 6.26365 numMergedOcc 0
16 mol 175 unq 1 iso 0 dist 7.7013 4.65504 7.77669 7.42278 7.04147 7.04177 numMergedOcc 0
17 mol 254 unq 0 iso 0 dist 9.91996 17.3639 9.84153 15.5495 10.7426 8.94909 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 9.80002 14.2814 6.59786 13.6013 7.10817 8.68913 numMergedOcc 0
19 mol 273 unq 1 iso 0 dist 9.80002 17.5382 7.96519 10.6229 4.30863 8.85779 numMergedOcc 0
20 mol 273 unq 2 iso 0 dist 6.73794 9.11005 6.59786 6.38341 7.10817 8.68913 numMergedOcc 0
21 mol 273 unq 3 iso 0 dist 6.73794 13.7838 7.96519 9.78826 4.30863 8.85779 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 6.90956 4.26276 8.40198 7.76945 8.32567 5.59555 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 6.90956 4.26276 8.40198 7.76945 8.32567 5.59555 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 6.90956 4.26276 8.40198 7.76945 8.32567 5.59555 numMergedOcc 0
